Vitas-M small molecule compound

(6Z)-3-(2-chlorophenyl)-6-(3-nitrobenzylidene)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one

Catalog ID
STK711700
SMILES Clc1ccccc1c1nnc2n1c(=O)/c(=C/c1cccc(c1)[N+](=O)[O-])/s2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H9ClN4O3S MW 384.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9ClN4O3S/c18-13-7-2-1-6-12(13)15-19-20-17-21(15)16(23)14(26-17)9-10-4-3-5-11(8-10)22(24)25/h1-9H/b14-9-
InChIKey
PQBKHWSSIDPFRG-ZROIWOOFSA-N
Synonyms

(6Z)3(2CHLOROPHENYL)6((3NITROPHENYL)METHYLIDENE)(13)THIAZOLO(23C)(124)TRIAZOL5ONE
(6Z)3(2chlorophenyl)6(3nitrobenzylidene)(13)thiazolo(23c)(124)triazol5(6H)one
(E)3(2chlorophenyl)6(3nitrobenzylidene)thiazolo(23c)(124)triazol5(6H)one
C1=CC=C(C(=C1)C2=NN=C3N2C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))S3)Cl
Clc1ccccc1c1nnc2n1c(=O)c(=Cc1cccc(c1)(N+)(=O)(O))s2
InChI=1SC17H9ClN4O3Sc1813721612(13)1519201721(15)16(23)14(2617)91043511(810)22(24)25h19Hb149
MFCD01821829
ZINC000001064062
ZINC01064062
ZINC1064062

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Available files

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